Molecule ID: mol17234

SMILES: COC(=O)c1ccc(OS(N)(=O)=O)cc1

InChI: InChI=1S/C8H9NO5S/c1-13-8(10)6-2-4-7(5-3-6)14-15(9,11)12/h2-5H,1H3,(H2,9,11,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.28 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization